| General Property |
| Molceule ID (DB) | EGIN0003204 |
| Inhibitor Class | Anilino-quinoline |
| Molecule Name in Refrence Article | 2 compound |
| IUPAC Name | 6-methoxy-7-[3-(morpholin-4-yl)propoxy]-4-[(4-phenoxyphenyl)amino]quinoline-3-carbonitrile |
| Formula | C30H30N4O4 |
| Mass | 510.5836 |
| Exact Mass | 510.2267055 |
| Composition | C (70.57%), H (5.92%), N (10.97%), O (12.53%) |
| Atom Count | 68 |
| PI | 12.38 |
| Smiles | c12c(c(C#N)cnc1cc(c(c2)OC)OCCCN1CCOCC1)Nc1ccc(Oc2ccccc2)cc1 |
| InChI | 1S/C30H30N4O4/c1-35-28-18-26-27(19-29(28)37-15-5-12-34-13-16-36-17-14-34)32-21-22(20-31)30(26)33-23-
8-10-25(11-9-23)38-24-6-3-2-4-7-24/h2-4,6-11,18-19,21H,5,12-17H2,1H3,(H,32,33) |
| InChIKey | LFTHSVHVSCMOQP-UHFFFAOYSA-N |
| 2D Structure |  | Structure Backbone |  |
|
| View Structure in Jmol | Click to view 3 d structure Download Mol File |
| Drug Like Property | Druglikeliness |
| Symmetry & Geometry | Symmetry And Geometrical Information |
| Activity & Binding | Activity against isoform and covalant binding information |
| Topological Properties | Descriptors |
| Reference | 12941327 |
| Compounds from Reference | Other compounds from reference |
| Find Similar Compounds | |
| Reported activity against other enzymes | P-Akt | P-MAPK | P-MEK1 | P-TYR | ALL |
| Pub Chem Link |
10324074
|
| Drug Bank Link | - |
| ChemSpider Link | 8499537 |
| ChEMBL Link | CHEMBL414139 |
